4-tert-butyl-3-[3-(2,6-dimethoxypyridin-3-yl)octanoylamino]benzoic acid

Systemtic Name: 4-tert-butyl-3-[3-(2,6-dimethoxypyridin-3-yl)octanoylamino]benzoic acid Openeye Name: 4-tert-butyl-3-[3-(2,6-dimethoxy-3-pyridyl)octanoylamino]benzoic acid CAS Name: 4-tert-butyl-3-[[3-(2,6-dimethoxy-3-pyridinyl)-1-oxooctyl]amino]benzoic acid IUPAC Name: 4-tert-butyl-3-[3-(2,6-dimethoxypyridin-3-yl)octanoylamino]benzoic acid Traditional Name: 4-tert-butyl-3-[3-(2,6-dimethoxy-3-pyridyl)octanoylamino]benzoic acid Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)O)C(C)(C)C)C2=C(N=C(C=C2)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)O)C(C)(C)C)C2=C(N=C(C=C2)OC)OC

InChI

InChI=1S/C26H36N2O5/c1-7-8-9-10-17(19-12-14-23(32-5)28-24(19)33-6)16-22(29)27-21-15-18(25(30)31)11-13-20(21)26(2,3)4/h11-15,17H,7-10,16H2,1-6H3,(H,27,29)(H,30,31)